SCHEMBL29940738

SCHEMBL29940738

COc1cc(OC)c(F)c(N=Cc2cnc(Cl)cc2Cl)c1F

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.34
KMT2A Q03164 5/20 0.34
MEN1 O00255 3/20 0.34
POLB P06746 3/20 0.34
RAB9A P51151 2/20 0.34
KCNQ3 O43525 1/20 0.34
KCNQ2 O43526 1/20 0.34
KDM4E B2RXH2 5/20 0.34
GAA P10253 5/20 0.34
HPGD P15428 3/20 0.34
LMNA P02545 3/20 0.34
HTT P42858 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HSP90AA1 P07900 1/20 0.34
KLF5 Q13887 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ALDH1A1 P00352 3/20 0.34
TP53 P04637 2/20 0.33
NPC1 O15118 1/20 0.33
NOX1 Q9Y5S8 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29940336 1.00 MAPT (0.34) MAPTKMT2AMEN1POLBRAB9A
SCHEMBL20569821 1.00 MAPT (0.34) MAPTKMT2AMEN1POLBRAB9A
SCHEMBL20943869 0.77 FGFR1 (0.46)
SCHEMBL18708653 0.77 FGFR1 (0.46)
SCHEMBL4403044 0.68 KDM4E (0.37) KDM4EHTTALDH1A1MAPK1
SCHEMBL4403038 0.68 KDM4E (0.37) KDM4EHTTALDH1A1MAPK1
SCHEMBL29940550 0.68 PDE5A (0.36) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL16176863 0.68 PDE5A (0.36) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL20073537 0.67 HPGD (0.38) MAPTKMT2AMEN1POLBRAB9A
SCHEMBL20225783 0.67 NPC1 (0.43) MAPTKMT2AMEN1POLBRAB9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115785090-A Crystalline forms of FGFR inhibitors and methods of making the same 因赛特公司 2023-03-14 CN disclosed
CN-111148745-B Crystalline forms of FGFR inhibitors and methods of making the same 因赛特公司 2022-11-11 CN disclosed